SCHEMBL9472174

SCHEMBL9472174

CC[C@H](CC(=O)O)OCCO

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP1A2 P05177 3/20 0.33
MAPK1 P28482 4/20 0.33
GMNN O75496 3/20 0.33
MAPT P10636 3/20 0.33
NPSR1 Q6W5P4 3/20 0.33
MEN1 O00255 2/20 0.33
HSP90AA1 P07900 2/20 0.33
BLM P54132 2/20 0.33
KMT2A Q03164 2/20 0.33
NR1H4 Q96RI1 2/20 0.33
TP53 P04637 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
HIF1A Q16665 1/20 0.33
SLC22A6 Q4U2R8 1/20 0.32
GLA P06280 1/20 0.32
PMP22 Q01453 1/20 0.32
MME P08473 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL498556 0.89 CYP1A2 (0.38) LMNASMN1; SMN2CYP1A2MAPK1GMNN
SCHEMBL5467590 0.87 SLC22A6 (0.38) LMNASMN1; SMN2CYP1A2MAPK1TSHR
SCHEMBL10904516 0.83 SLC22A6 (0.35) LMNASMN1; SMN2SLC22A6MMETDP1
SCHEMBL2223328 0.82 CYP1A2 (0.42) LMNACYP1A2MAPK1GMNNMAPT
SCHEMBL15199823 0.82 TSHR (0.35) LMNASMN1; SMN2CYP1A2MAPK1GMNN
Water SCHEMBL9651581 0.81 SLC22A6 (0.33) LMNASMN1; SMN2SLC22A6TDP1
SCHEMBL25825 0.80 LMNA (0.38) LMNASMN1; SMN2CYP1A2MAPK1GMNN
SCHEMBL1118391 0.80 MAPK1 (0.35) LMNASMN1; SMN2MAPK1MMEACE
SCHEMBL9472747 0.80 TSHR (0.34) TSHR
SCHEMBL1441851 0.79

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5264547-A Optically active ether lactone, optically active polymer thereof, and process for producing the polymer TAKASAGO INTERNATIONAL CORPORATION (JP) 1993-11-23 US disclosed
US-5221755-A Optically active ether lactone, optically active polymer thereof, and process for producing the polymer TAKASAGO INTERNATIONAL CORPORATION (JP) 1993-06-22 US disclosed